Methyl (S)-5-(3-(1-((2-hydroxyethyl)amino)-2,3-dihydro-1H-inden-4-yl)-1,2,4-oxadiazol-5-yl)-2-isopropoxybenzoate hydrochloride

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H27N3O5.ClH
Molecular Weight	473.949
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Methyl (S)-5-(3-(1-((2-hydroxyethyl)amino)-2,3-dihydro-1H-inden-4-yl)-1,2,4-oxadiazol-5-yl)-2-isopropoxybenzoate hydrochloride

Structure Search

SMILES

Cl.COC(=O)C1=C(OC(C)C)C=CC(=C1)C2=NC(=NO2)C3=C4CC[C@H](NCCO)C4=CC=C3

InChI

InChIKey=MXTATVUDPUITLU-BDQAORGHSA-N

InChI=1S/C24H27N3O5.ClH/c1-14(2)31-21-10-7-15(13-19(21)24(29)30-3)23-26-22(27-32-23)18-6-4-5-17-16(18)8-9-20(17)25-11-12-28;/h4-7,10,13-14,20,25,28H,8-9,11-12H2,1-3H3;1H/t20-;/m0./s1

HIDE SMILES / InChI

Molecular Formula	C24H27N3O5
Molecular Weight	437.4883
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 21:13:52 GMT 2025` Edited by `admin` on `Wed Apr 02 21:13:52 GMT 2025`
Record UNII	4QD647L4W9
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

Methyl (S)-5-(3-(1-((2-hydroxyethyl)amino)-2,3-dihydro-1H-inden-4-yl)-1,2,4-oxadiazol-5-yl)-2-isopropoxybenzoate hydrochloride

Systematic Name

English

Benzoic acid, 5-[3-[(1S)-2,3-dihydro-1-[(2-hydroxyethyl)amino]-1H-inden-4-yl]-1,2,4-oxadiazol-5-yl]-2-(1-methylethoxy)-, methyl ester, hydrochloride (1:1)

Preferred Name

English

Code System Code Type Description

CAS

2918298-58-3

Created by admin on Wed Apr 02 21:13:52 GMT 2025 , Edited by admin on Wed Apr 02 21:13:52 GMT 2025

PRIMARY

FDA UNII

4QD647L4W9

Created by admin on Wed Apr 02 21:13:52 GMT 2025 , Edited by admin on Wed Apr 02 21:13:52 GMT 2025

PRIMARY